Geometry & MOs

Info

ID:	24333
PubChem CID:	609359
Reduced:	N2O3H8C10 (1)
Stoich.:	A2B3C8D10 (1)
Weight, g/mol:	204.053492
ΔH_f, kcal/mol:	-5.71
Dipole, Da:	11.28
IP(EA), eV:	-9.49(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-5-nitro-1H-indole-3-carbaldehyde

Drug info:

PubChemData

Smile

CC1=C(C2=C(N1)C=CC(=C2)[N+](=O)[O-])C=O

DOS

IR

Vibrations