Geometry & MOs

Info

ID:	403346
PubChem CID:	135059821
Reduced:	ON2H26C32 (1)
Stoich.:	AB2C26D32 (1)
Weight, g/mol:	401.093104
ΔH_f, kcal/mol:	69.72
Dipole, Da:	3.63
IP(EA), eV:	-7.95(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-(7-chloroquinolin-2-yl)-4-methyl-9H-pyrido[3,4-b]indole-3-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=CC3=C(C(=O)N2C4=CC=C(C=C4)C)N(C5=CC=CC=C53)CC6=CC=CC=C6

DOS

IR

Vibrations