Geometry & MOs

Info

ID:	397175
PubChem CID:	135029846
Reduced:	SN2O2C24H28 (1)
Stoich.:	AB2C2D24E28 (1)
Weight, g/mol:	308.098334
ΔH_f, kcal/mol:	-58.16
Dipole, Da:	3.47
IP(EA), eV:	-9.22(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(9R,9aS)-2'-methylspiro[4,5,8,9a-tetrahydrothieno[3,2-g]indolizine-9,3'-indole]-7-one

Drug info:

PubChemData

Smile

CC(=O)N[C@H]1CSC2C(CCCN2C1=O)(CC3=CC=CC=C3)CC4=CC=CC=C4

DOS

IR

Vibrations