Geometry & MOs

Info

ID:	279296
PubChem CID:	103842936
Reduced:	ClNSO2C13H18 (1)
Stoich.:	ABCD2E13F18 (1)
Weight, g/mol:	237.154035
ΔH_f, kcal/mol:	-93.68
Dipole, Da:	4.01
IP(EA), eV:	-8.95(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,3-difluoro-2-hydroxypropyl)-2-propylpentanamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)Cl)C(=O)NCCSCCCO

DOS

IR

Vibrations