Geometry & MOs

Info

ID:	334499
PubChem CID:	127253174
Reduced:	N3O4C26H33 (1)
Stoich.:	A3B4C26D33 (1)
Weight, g/mol:	510.19215
ΔH_f, kcal/mol:	-125.44
Dipole, Da:	3.37
IP(EA), eV:	-8.01(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,5'R)-3'-[(1-benzylpiperidin-4-yl)amino]-7-chloro-4,6-dimethoxy-5'-methylspiro[1-benzofuran-2,6'-cyclohex-2-ene]-1',3-dione

Drug info:

PubChemData

Smile

CC(C)C(C1=CC(=C(C=C1)OC)OC)NC(=O)NC2CCCC3=C2NC4=C3C=C(C=C4)OC

DOS

IR

Vibrations