Geometry & MOs

Info

ID:	251189
PubChem CID:	103102067
Reduced:	ISN2C9H15 (1)
Stoich.:	ABC2D9E15 (1)
Weight, g/mol:	226.240899
ΔH_f, kcal/mol:	41.49
Dipole, Da:	2.32
IP(EA), eV:	-8.86(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-ethyl-N'-[[1-(2-methylpropyl)cyclopentyl]methyl]ethane-1,2-diamine

Drug info:

PubChemData

Smile

CCN(CCN)CC1=CSC(=C1)I

DOS

IR

Vibrations