Geometry & MOs

Info

ID:	302302
PubChem CID:	124361163
Reduced:	NSO7C23H25 (1)
Stoich.:	ABC7D23E25 (1)
Weight, g/mol:	489.04548
ΔH_f, kcal/mol:	-264.94
Dipole, Da:	1.99
IP(EA), eV:	-8.77(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S,8S)-5'-bromo-N-(5-chloro-2-methoxyphenyl)-2'-oxospiro[1,2,5,6,7,8-hexahydropyrrolizine-3,3'-1H-indole]-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N[C@@H](CCSC)C(=O)OC1=CC(=C2C(=C1)OC3=CC=CC=C3C2=O)O

DOS

IR

Vibrations