Geometry & MOs

Info

ID:	438709
PubChem CID:	135228460
Reduced:	NO3C21H21 (1)
Stoich.:	AB3C21D21 (1)
Weight, g/mol:	369.154035
ΔH_f, kcal/mol:	-90.92
Dipole, Da:	3.66
IP(EA), eV:	-9.02(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(difluoromethylidene)-4-hydroxy-7-propan-2-yl-2,3-dihydroinden-5-yl]-(1,3-dihydroisoindol-2-yl)methanone

Drug info:

PubChemData

Smile

CC(C)C1=CC(=C(C2=C1C(=O)CC2)O)C(=O)N3CC4=CC=CC=C4C3

DOS

IR

Vibrations