Geometry & MOs

Info

ID:	342873
PubChem CID:	127266036
Reduced:	N2O3C13H20 (1)
Stoich.:	A2B3C13D20 (1)
Weight, g/mol:	328.215078
ΔH_f, kcal/mol:	-105.52
Dipole, Da:	5.34
IP(EA), eV:	-9.37(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aS,6aS)-N-(2,6-dimethylphenyl)spiro[2,3a,4,5,6,6a-hexahydrocyclopenta[b]pyrrole-3,4'-oxane]-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)NC(=O)NOC(C)(C)CO

DOS

IR

Vibrations