Geometry & MOs

Info

ID:	281426
PubChem CID:	103913858
Reduced:	NC5H7 (3)
Stoich.:	AB5C7 (3)
Weight, g/mol:	263.155515
ΔH_f, kcal/mol:	35.97
Dipole, Da:	3.97
IP(EA), eV:	-9.02(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-1-[(2-methylsulfonylcyclopentyl)amino]pentan-2-ol

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)CNC(C)C2=NC=CN2C

DOS

IR

Vibrations