Geometry & MOs

Info

ID:	38243
PubChem CID:	8028414
Reduced:	N2O4C25H34 (1)
Stoich.:	A2B4C25D34 (1)
Weight, g/mol:	324.12224
ΔH_f, kcal/mol:	-186.27
Dipole, Da:	3.0
IP(EA), eV:	-9.02(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(2,4-dioxo-1H-quinazolin-3-yl)-N-pyridin-3-ylbutanamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1CC(NC(C1)(C)C)(C)C)OC2=CC3=C(C=C2)C4=C(CCCC4)C(=O)O3

DOS

IR

Vibrations