Geometry & MOs

Info

ID:	247608
PubChem CID:	103072387
Reduced:	ON2C14H22 (1)
Stoich.:	AB2C14D22 (1)
Weight, g/mol:	179.105862
ΔH_f, kcal/mol:	-36.96
Dipole, Da:	4.27
IP(EA), eV:	-8.67(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(aminomethyl)prop-2-enyl]-5-methylpyrimidin-2-one

Drug info:

PubChemData

Smile

CC1=CC=CN(C1=O)CC(=C)CNC(C)(C)C

DOS

IR

Vibrations