Geometry & MOs

Info

ID:	307961
PubChem CID:	125310953
Reduced:	N2O6C29H34 (1)
Stoich.:	A2B6C29D34 (1)
Weight, g/mol:	369.122575
ΔH_f, kcal/mol:	-201.65
Dipole, Da:	3.04
IP(EA), eV:	-8.52(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S,7aR)-6-amino-1'-methyl-2'-oxo-3-phenylspiro[7aH-pyrano[2,3-c]pyrazole-4,3'-indole]-5-carbonitrile

Drug info:

PubChemData

Smile

CC[C@@H]1CC(=O)OC2=C3CCC(OC3=CC(=C12)OCC(=O)NCCC4=C5C=C(C=CC5=NC4)OC)(C)C

DOS

IR

Vibrations