Geometry & MOs

Info

ID:	143422
PubChem CID:	53207128
Reduced:	NOC11H13 (2)
Stoich.:	ABC11D13 (2)
Weight, g/mol:	408.135304
ΔH_f, kcal/mol:	-49.0
Dipole, Da:	2.17
IP(EA), eV:	-8.5(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-chlorophenyl)ethyl]-2-(3-methyl-4-oxopyridazino[4,5-b]indol-5-yl)propanamide

Drug info:

PubChemData

Smile

CCC(C)NCC1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3C)C(=O)O

DOS

IR

Vibrations