Geometry & MOs

Info

ID:	209760
PubChem CID:	80716286
Reduced:	NOC15H31 (1)
Stoich.:	ABC15D31 (1)
Weight, g/mol:	255.107085
ΔH_f, kcal/mol:	-97.46
Dipole, Da:	2.7
IP(EA), eV:	-9.03(2.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-difluorophenyl)-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide

Drug info:

PubChemData

Smile

CCCCCC(CCCCC)NC1CCOC1

DOS

IR

Vibrations