Geometry & MOs

Info

ID:	313215
PubChem CID:	126612618
Reduced:	ClN2O2C13H25 (1)
Stoich.:	AB2C2D13E25 (1)
Weight, g/mol:	248.129156
ΔH_f, kcal/mol:	-147.54
Dipole, Da:	4.53
IP(EA), eV:	-9.88(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chloroethyl)-N,N'-dipropylpropanediamide

Drug info:

PubChemData

Smile

CCCCNC(=O)C(CCCl)C(=O)NCCCC

DOS

IR

Vibrations