Geometry & MOs

Info

ID:	175451
PubChem CID:	75907252
Reduced:	O3N4C25H38 (1)
Stoich.:	A3B4C25D38 (1)
Weight, g/mol:	428.278741
ΔH_f, kcal/mol:	-151.21
Dipole, Da:	7.65
IP(EA), eV:	-9.18(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-2,4-dioxo-N,7-di(propan-2-yl)-1-propyl-4a,5,6,7,8,8a-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide

Drug info:

PubChemData

Smile

CC(C)CN1C2C(C(CC(N2)C(C)C)C(=O)N(CC3=CC=CC=C3)C(C)C)C(=O)NC1=O

DOS

IR

Vibrations