Geometry & MOs

Info

ID:	143757
PubChem CID:	53254776
Reduced:	NO3C17H19 (1)
Stoich.:	AB3C17D19 (1)
Weight, g/mol:	348.168522
ΔH_f, kcal/mol:	-85.48
Dipole, Da:	3.49
IP(EA), eV:	-8.43(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]carbamoyl]benzoic acid

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1C(=O)NC2=C(C=CC(=C2)OC)OC

DOS

IR

Vibrations