Geometry & MOs

Info

ID:	232746
PubChem CID:	87576863
Reduced:	NOSC12H27 (1)
Stoich.:	ABCD12E27 (1)
Weight, g/mol:	484.214427
ΔH_f, kcal/mol:	-80.76
Dipole, Da:	3.35
IP(EA), eV:	-8.36(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-[3-[methoxy(methyl)amino]propylsulfonyl]piperidin-4-yl]-5-phenyl-1H-indole-7-carboxamide

Drug info:

PubChemData

Smile

CCCCCCCCNS(=O)C(C)CC

DOS

IR

Vibrations