Geometry & MOs

Info

ID:	172210
PubChem CID:	75479976
Reduced:	O3N4C19H20 (1)
Stoich.:	A3B4C19D20 (1)
Weight, g/mol:	325.179027
ΔH_f, kcal/mol:	-36.99
Dipole, Da:	2.7
IP(EA), eV:	-8.84(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopentyl-N-[4-(6-methyl-4-oxo-1H-pyrimidin-2-yl)phenyl]propanamide

Drug info:

PubChemData

Smile

COCCNC(=O)N/N=C/1\C2=CC=CC=C2N(C1=O)CC3=CC=CC=C3

DOS

IR

Vibrations