Geometry & MOs

Info

ID:	281797
PubChem CID:	103914379
Reduced:	NSO2C13H27 (1)
Stoich.:	ABC2D13E27 (1)
Weight, g/mol:	235.204848
ΔH_f, kcal/mol:	-127.22
Dipole, Da:	4.27
IP(EA), eV:	-8.84(0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-ethylcyclopentyl)methyl]-1-(1-methylimidazol-2-yl)ethanamine

Drug info:

PubChemData

Smile

CCC1(CCCC1)CNC(C)CS(=O)(=O)CC

DOS

IR

Vibrations