Geometry & MOs

Info

ID:	202898
PubChem CID:	79740528
Reduced:	NOSC13H13 (1)
Stoich.:	ABCD13E13 (1)
Weight, g/mol:	246.136828
ΔH_f, kcal/mol:	8.97
Dipole, Da:	3.55
IP(EA), eV:	-9.06(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-amino-2,3-dihydro-1H-inden-1-yl)oxolane-3-carboxamide

Drug info:

PubChemData

Smile

C1CC2=C(C1C(C3=CSC=C3)O)N=CC=C2

DOS

IR

Vibrations