Geometry & MOs

Info

ID:	420892
PubChem CID:	135115001
Reduced:	NO2C8H9 (2)
Stoich.:	AB2C8D9 (2)
Weight, g/mol:	365.173942
ΔH_f, kcal/mol:	-98.04
Dipole, Da:	2.92
IP(EA), eV:	-9.55(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(6-methoxyspiro[3,4-dihydroisochromene-1,4'-piperidine]-1'-carbonyl)-1-methylpyrrole-3-carbonitrile

Drug info:

PubChemData

Smile

CC1(CCCO1)CNC2=NOC(=C2C(=O)O)C3=CC=CC=C3

DOS

IR

Vibrations