Geometry & MOs

Info

ID:	200243
PubChem CID:	79371304
Reduced:	FNO3C14H18 (1)
Stoich.:	ABC3D14E18 (1)
Weight, g/mol:	272.188863
ΔH_f, kcal/mol:	-156.68
Dipole, Da:	1.76
IP(EA), eV:	-9.04(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-4-methyl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole

Drug info:

PubChemData

Smile

CC1C(CCN1CCOC2=CC=C(C=C2)F)C(=O)O

DOS

IR

Vibrations