Geometry & MOs

Info

ID:	139582
PubChem CID:	52563914
Reduced:	SF2N3O3C24H25 (1)
Stoich.:	AB2C3D3E24F25 (1)
Weight, g/mol:	435.127107
ΔH_f, kcal/mol:	-157.71
Dipole, Da:	5.1
IP(EA), eV:	-9.07(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-chlorophenyl)sulfonyl-N-[(1S)-1-cyclopropylethyl]-N-[(4-methoxyphenyl)methyl]propanamide

Drug info:

PubChemData

Smile

CCOC(=O)[C@H](C1=C(N(N=C1C)C2=CC=C(C=C2)F)C)NC(=O)CCSC3=CC=CC=C3F

DOS

IR

Vibrations