Geometry & MOs

Info

ID:	346227
PubChem CID:	127270718
Reduced:	ON2C18H22 (1)
Stoich.:	AB2C18D22 (1)
Weight, g/mol:	288.150764
ΔH_f, kcal/mol:	-26.55
Dipole, Da:	2.17
IP(EA), eV:	-8.43(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-(1-methylsulfonylpiperidin-4-yl)cyclopentane-1-carboxamide

Drug info:

PubChemData

Smile

CC1(CCCC1)C(=O)N2CCC3=C(C2)C4=CC=CC=C4N3

DOS

IR

Vibrations