Geometry & MOs

Info

ID:	403476
PubChem CID:	135060475
Reduced:	IO2N3H20C26 (1)
Stoich.:	AB2C3D20E26 (1)
Weight, g/mol:	308.071641
ΔH_f, kcal/mol:	9.99
Dipole, Da:	4.65
IP(EA), eV:	-8.28(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-chlorophenyl)methyl]-2,5-dihydropyrido[4,3-b]indol-3-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)C2=C3C(=CN(C2=O)C4=CC=C(C=C4)C)C5=C(N3)C=CC=C5I

DOS

IR

Vibrations