Geometry & MOs

Info

ID:	352928
PubChem CID:	127284018
Reduced:	SN2O3C20H28 (1)
Stoich.:	AB2C3D20E28 (1)
Weight, g/mol:	396.150764
ΔH_f, kcal/mol:	-113.81
Dipole, Da:	1.26
IP(EA), eV:	-9.43(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-(4-methylidenepiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCC(=C)CC3)C

DOS

IR

Vibrations