Geometry & MOs

Info

ID:	67305
PubChem CID:	46506248
Reduced:	N2O3C14H17 (2)
Stoich.:	A2B3C14D17 (2)
Weight, g/mol:	524.170727
ΔH_f, kcal/mol:	-225.69
Dipole, Da:	13.4
IP(EA), eV:	-8.92(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-[2-(4-fluoroanilino)-2-oxoethyl]-6,7-dimethoxy-2,4-dioxoquinazolin-3-yl]-N-(furan-2-ylmethyl)propanamide

Drug info:

PubChemData

Smile

COC1=C(C=C2C(=C1)C(=O)N(C(=O)N2CC(=O)NC3CCCCC3)CCC(=O)NCC4=CC=CC=C4)OC

DOS

IR

Vibrations