Geometry & MOs

Info

ID:	61978
PubChem CID:	26716469
Reduced:	N2O5C20H22 (1)
Stoich.:	A2B5C20D22 (1)
Weight, g/mol:	464.117271
ΔH_f, kcal/mol:	-131.55
Dipole, Da:	4.43
IP(EA), eV:	-9.11(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 4-[(2-chloro-5-piperidin-1-ylsulfonylbenzoyl)amino]benzoate

Drug info:

PubChemData

Smile

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CO/N=C\C2=CC=C(C=C2)OC

DOS

IR

Vibrations