Geometry & MOs

Info

ID:	243884
PubChem CID:	99300566
Reduced:	SN4O5C23H26 (1)
Stoich.:	AB4C5D23E26 (1)
Weight, g/mol:	468.183127
ΔH_f, kcal/mol:	-143.97
Dipole, Da:	7.6
IP(EA), eV:	-8.35(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,2-dimethylimidazol-4-yl)sulfonyl-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)CSCCOC3=CC=C(C=C3)OC

DOS

IR

Vibrations