Geometry & MOs

Info

ID:	123060
PubChem CID:	50831753
Reduced:	O3N6C25H30 (1)
Stoich.:	A3B6C25D30 (1)
Weight, g/mol:	484.178041
ΔH_f, kcal/mol:	-35.77
Dipole, Da:	2.7
IP(EA), eV:	-8.28(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethylphenyl)-1-methyl-2,4-dioxo-3-(3-oxo-3-pyrrolidin-1-ylpropyl)quinazoline-6-sulfonamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)CN2C3=C(C=C(C=C3)C)C4=C2C(=O)N(C=N4)CC5=NC(=NO5)C(C)C

DOS

IR

Vibrations