Geometry & MOs

Info

ID:	126040
PubChem CID:	50949354
Reduced:	O3N4H20C21 (1)
Stoich.:	A3B4C20D21 (1)
Weight, g/mol:	375.179421
ΔH_f, kcal/mol:	4.57
Dipole, Da:	2.99
IP(EA), eV:	-8.75(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,5-dimethoxyphenyl)methyl]-N-(1-methoxypropan-2-yl)-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=CN2C1=NC=C2CC(=O)NCC3=CC(=NO3)C4=CC=C(C=C4)OC

DOS

IR

Vibrations