Geometry & MOs

Info

ID:	322090
PubChem CID:	126668554
Reduced:	NOC16H21 (1)
Stoich.:	ABC16D21 (1)
Weight, g/mol:	335.163377
ΔH_f, kcal/mol:	-29.89
Dipole, Da:	2.07
IP(EA), eV:	-8.63(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-butan-2-ylphenyl)-9-methyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide

Drug info:

PubChemData

Smile

C1C2CC3CC1[C@H](C3N(C2)CC4=CC=CC=C4)O

DOS

IR

Vibrations