Geometry & MOs

Info

ID:	131037
PubChem CID:	51148152
Reduced:	SN2O3C18H24 (1)
Stoich.:	AB2C3D18E24 (1)
Weight, g/mol:	390.197714
ΔH_f, kcal/mol:	-120.32
Dipole, Da:	6.65
IP(EA), eV:	-8.94(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]sulfanyl-N-(oxolan-2-ylmethyl)benzamide

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)CSC2=CC=CC=C2C(=O)NCC3CCCO3

DOS

IR

Vibrations