Geometry & MOs

Info

ID:	173962
PubChem CID:	75705648
Reduced:	ClSN2O5C22H29 (1)
Stoich.:	ABC2D5E22F29 (1)
Weight, g/mol:	382.202321
ΔH_f, kcal/mol:	-179.85
Dipole, Da:	2.86
IP(EA), eV:	-9.71(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-chloroacetyl)-(furan-2-ylmethyl)amino]-N-cyclohexyl-3-ethylpentanamide

Drug info:

PubChemData

Smile

CCC(CC)C(C(=O)NCS(=O)(=O)C1=CC=C(C=C1)C)N(CC2=CC=CO2)C(=O)CCl

DOS

IR

Vibrations