Geometry & MOs

Info

ID:	364675
PubChem CID:	127315970
Reduced:	SO2N3C21H25 (1)
Stoich.:	AB2C3D21E25 (1)
Weight, g/mol:	383.220892
ΔH_f, kcal/mol:	-60.53
Dipole, Da:	5.93
IP(EA), eV:	-8.38(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-carbamoyl-3-piperidin-1-ylphenyl)-9-oxobicyclo[3.3.1]nonane-3-carboxamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=C(C=CC(=C2)NC(=O)C3=CSC4=C3CCCC4)C(=O)N

DOS

IR

Vibrations