Geometry & MOs

Info

ID:	165922
PubChem CID:	74614619
Reduced:	N3O4H23C24 (1)
Stoich.:	A3B4C23D24 (1)
Weight, g/mol:	421.200156
ΔH_f, kcal/mol:	-82.04
Dipole, Da:	1.84
IP(EA), eV:	-8.92(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[benzyl(propan-2-yl)amino]-2-oxoethyl] 4-(4-oxo-4aH-quinazolin-2-yl)butanoate

Drug info:

PubChemData

Smile

CC1(C(=O)N(C(=O)N1)NC(=O)COC2=CC3=CC=CC=C3C=C2)CCC4=CC=CC=C4

DOS

IR

Vibrations