Geometry & MOs

Info

ID:	359494
PubChem CID:	127298768
Reduced:	SO2N3C21H31 (1)
Stoich.:	AB2C3D21E31 (1)
Weight, g/mol:	353.213698
ΔH_f, kcal/mol:	-86.99
Dipole, Da:	6.06
IP(EA), eV:	-8.93(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylcyclohexyl)-2-[2-(thiomorpholine-4-carbonyl)pyrrolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C(C)NC(=O)CN2CCCC2C(=O)N3CCSCC3

DOS

IR

Vibrations