Geometry & MOs

Info

ID:	138535
PubChem CID:	52382074
Reduced:	O3N4H26C31 (1)
Stoich.:	A3B4C26D31 (1)
Weight, g/mol:	502.200491
ΔH_f, kcal/mol:	-9.28
Dipole, Da:	4.18
IP(EA), eV:	-9.1(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2R)-1'-methyl-2',4-dioxospiro[1H-quinazoline-2,3'-indole]-3-yl]-N-[(1S)-1-phenylethyl]benzamide

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4N[C@@]35C6=CC=CC=C6N(C5=O)C

DOS

IR

Vibrations