Geometry & MOs

Info

ID:	366992
PubChem CID:	127322540
Reduced:	SN3O3C20H29 (1)
Stoich.:	AB3C3D20E29 (1)
Weight, g/mol:	350.210661
ΔH_f, kcal/mol:	-111.46
Dipole, Da:	6.18
IP(EA), eV:	-9.38(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-imidazol-1-ylphenyl)methyl]-2-azaspiro[5.5]undec-9-ene-2-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)S(=O)(=O)NC)NC(=O)N2CCCC3(C2)CCC=CC3

DOS

IR

Vibrations