Geometry & MOs

Info

ID:	184406
PubChem CID:	77156931
Reduced:	S2N6O6C35H44 (1)
Stoich.:	A2B6C6D35E44 (1)
Weight, g/mol:	524.231122
ΔH_f, kcal/mol:	-170.4
Dipole, Da:	7.01
IP(EA), eV:	-8.91(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclohexylethyl)-2-[(2'-oxospiro[6H-furo[2,3-f][1,3]benzodioxole-7,3'-indole]-1'-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCN(CC(CC1=CC=CC=C1)N(C2=CN=CS2)C(=O)OC)CC(CC3=CC=CC=C3)N(C4=CN=CS4)C(=O)OC

DOS

IR

Vibrations