Geometry & MOs

Info

ID:	343414
PubChem CID:	127266587
Reduced:	O3N4C14H24 (1)
Stoich.:	A3B4C14D24 (1)
Weight, g/mol:	317.065256
ΔH_f, kcal/mol:	-137.21
Dipole, Da:	1.87
IP(EA), eV:	-9.54(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R,2S)-2-(4-chloro-3-fluorophenyl)cyclopropyl]-2-methyl-3-methylsulfinylpropanamide

Drug info:

PubChemData

Smile

CCC(CC#N)NC(=O)[C@H](C)NC(=O)NCC1CCCO1

DOS

IR

Vibrations