Geometry & MOs

Info

ID:	195326
PubChem CID:	78672383
Reduced:	N3O7C20H25 (1)
Stoich.:	A3B7C20D25 (1)
Weight, g/mol:	409.182398
ΔH_f, kcal/mol:	-289.25
Dipole, Da:	2.29
IP(EA), eV:	-8.4(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-oxo-3-(1-phenylethyl)quinazolin-2-yl]sulfanyl-N-pentan-3-ylacetamide

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)NC(=O)COC(=O)C1CC(=O)N(C1)C2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations