Geometry & MOs

Info

ID:	67286
PubChem CID:	46506211
Reduced:	BrN3O4C18H24 (1)
Stoich.:	AB3C4D18E24 (1)
Weight, g/mol:	381.132471
ΔH_f, kcal/mol:	-177.89
Dipole, Da:	3.44
IP(EA), eV:	-9.53(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-acetylphenyl)-3-(2-methoxyethyl)-2,4-dioxo-1H-quinazoline-7-carboxamide

Drug info:

PubChemData

Smile

CC(C)OCCCNC(=O)CCCN1C(=O)C2=C(C=CC(=C2)Br)NC1=O

DOS

IR

Vibrations