Geometry & MOs

Info

ID:	177891
PubChem CID:	76249586
Reduced:	N2O5C26H34 (1)
Stoich.:	A2B5C26D34 (1)
Weight, g/mol:	363.158292
ΔH_f, kcal/mol:	-148.7
Dipole, Da:	4.85
IP(EA), eV:	-8.61(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-4-(4-oxo-4aH-quinazolin-2-yl)butanamide

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)C=CC(=O)NCC(C)N2CCOCC2)OCCOC3=CC=CC=C3

DOS

IR

Vibrations