Geometry & MOs

Info

ID:	181277
PubChem CID:	76727518
Reduced:	NOH3C4 (5)
Stoich.:	ABC3D4 (5)
Weight, g/mol:	371.163377
ΔH_f, kcal/mol:	-3.44
Dipole, Da:	12.67
IP(EA), eV:	-8.98(-1.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[3-(dimethylamino)prop-2-enoyl]phenyl]-5-methylpyrido[3,2-b]indol-2-one

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C3=C1C=C(C(=O)N3C4=CC=C(C=C4)[N+](=O)[O-])C5NC(=O)ON5

DOS

IR

Vibrations