Formula |
C13H11N3O |
IUPAC Name |
2-methylpyrido[3,2-c][1,5]benzodiazepine-6,11-diium-5-one |
Molecular Mass |
225.246 g·mol−1 |
Heat of Formation |
68.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.33 ± 1.08 D |
Volume |
257.56 Å 3 |
Surface Area |
243.16 Å 2 |
HOMO Energy |
-8.63 ± 0.55 eV |
LUMO Energy |
-0.77 ± eV |
Point Group Symmetry |
C1
|
Synonyms
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- ,
- -
- 1
- 2
- 3
- 5
- 6
- [
- ]
- a
- b
- c
- d
- e
- h
- i
- l
- m
- n
- o
- p
- r
- t
- y
- z
|
InChIKey |
QCDYMKKLCBKXRR-UHFFFAOYSA-N |
QR Code |
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Links |
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|
DOI |
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Downloads |
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|
Elements |
H
C
O
N
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