Geometry & MOs

Info

ID:	418092
PubChem CID:	135103502
Reduced:	ON4C17H22 (1)
Stoich.:	AB4C17D22 (1)
Weight, g/mol:	323.144533
ΔH_f, kcal/mol:	-1.4
Dipole, Da:	0.7
IP(EA), eV:	-8.67(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,4-difluorophenyl)-N-(2-hydroxyethyl)-N-[(3-methylimidazol-4-yl)methyl]propanamide

Drug info:

PubChemData

Smile

CCC1=CN=C(N=C1N2CCC(CC2)C3=CC(=CC=C3)O)N

DOS

IR

Vibrations