Geometry & MOs

Info

ID:	403326
PubChem CID:	135059743
Reduced:	SN3O5H29C30 (1)
Stoich.:	AB3C5D29E30 (1)
Weight, g/mol:	304.121178
ΔH_f, kcal/mol:	-116.52
Dipole, Da:	6.11
IP(EA), eV:	-8.6(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-5-(2-methyl-9H-pyrido[2,3-b]indol-4-yl)phenol

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1C2=CC=CC=C2C3=C(C(=NC=C31)N(C4=CC=CC=C4)S(=O)(=O)C)C5=CC=C(C=C5)OC

DOS

IR

Vibrations