Geometry & MOs

Info

ID:	89831
PubChem CID:	49964897
Reduced:	FOSN4H13C19 (1)
Stoich.:	ABCD4E13F19 (1)
Weight, g/mol:	315.20591
ΔH_f, kcal/mol:	34.76
Dipole, Da:	4.82
IP(EA), eV:	-9.28(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-1'-propan-2-yl-3-propylspiro[2H-pyrano[2,3-c]pyrazole-4,4'-piperidine]-5-carbonitrile

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)F)NC(=O)CSC2=C(C=CC(=N2)C3=CC=NC=C3)C#N

DOS

IR

Vibrations