Geometry & MOs

Info

ID:	142561
PubChem CID:	53057909
Reduced:	N3O4C23H29 (1)
Stoich.:	A3B4C23D29 (1)
Weight, g/mol:	429.146425
ΔH_f, kcal/mol:	-137.56
Dipole, Da:	5.21
IP(EA), eV:	-8.34(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7-fluorospiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]-1'-yl)-[2-(trifluoromethyl)phenyl]methanone

Drug info:

PubChemData

Smile

CC(C1CCN(CC1)C(=O)NC2=CC=CC=C2)C(=O)NC3=C(C=C(C=C3)OC)OC

DOS

IR

Vibrations