Geometry & MOs

Info

ID:	290749
PubChem CID:	109979047
Reduced:	NOC9H14 (2)
Stoich.:	ABC9D14 (2)
Weight, g/mol:	321.128883
ΔH_f, kcal/mol:	-107.07
Dipole, Da:	2.86
IP(EA), eV:	-9.29(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3,4-difluorophenyl)-1-hydroxypropan-2-yl]-2,4-dimethylpyrimidine-5-carboxamide

Drug info:

PubChemData

Smile

CCC(C1=CC=C(C=C1)C)NC(=O)N2CCCCC2CCO

DOS

IR

Vibrations