Geometry & MOs

Info

ID:	358780
PubChem CID:	127296646
Reduced:	N2O3C16H16 (1)
Stoich.:	A2B3C16D16 (1)
Weight, g/mol:	334.135114
ΔH_f, kcal/mol:	-79.07
Dipole, Da:	3.67
IP(EA), eV:	-9.41(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methylidenepiperidin-1-yl)-(4-pyrrolidin-1-ylsulfonylphenyl)methanone

Drug info:

PubChemData

Smile

C=C1CCN(CC1)C(=O)CN2C(=O)C3=CC=CC=C3C2=O

DOS

IR

Vibrations