Geometry & MOs

Info

ID:	403387
PubChem CID:	135059967
Reduced:	ON2H14C21 (1)
Stoich.:	AB2C14D21 (1)
Weight, g/mol:	336.066555
ΔH_f, kcal/mol:	61.6
Dipole, Da:	4.15
IP(EA), eV:	-8.02(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(4-chlorophenyl)-5H-pyrido[4,3-b]indole-4-carboxylate

Drug info:

PubChemData

Smile

C1=CC=C\2C(=C1)C=CC(=O)/C2=C\3/C=CC4=C(N3)NC5=CC=CC=C45

DOS

IR

Vibrations