Geometry & MOs

Info

ID:	50669
PubChem CID:	12013242
Reduced:	N2O3C16H22 (1)
Stoich.:	A2B3C16D22 (1)
Weight, g/mol:	258.136828
ΔH_f, kcal/mol:	-132.37
Dipole, Da:	3.8
IP(EA), eV:	-9.48(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S,4aS)-4-(2-methylphenyl)-4,4a,5,6,7,8-hexahydropyrido[1,2-c]pyrimidine-1,3-dione

Drug info:

PubChemData

Smile

CCOC(=O)N1CCCCC1C(C2=CC=CC=C2)C(=O)N

DOS

IR

Vibrations