Geometry & MOs

Info

ID:	313217
PubChem CID:	126612627
Reduced:	ClN2O2H17C21 (1)
Stoich.:	AB2C2D17E21 (1)
Weight, g/mol:	244.097856
ΔH_f, kcal/mol:	54.7
Dipole, Da:	3.23
IP(EA), eV:	-9.15(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chloroethyl)-N,N'-bis(prop-2-enyl)propanediamide

Drug info:

PubChemData

Smile

C#CC1=CC(=CC=C1)NC(=O)C(CCCl)C(=O)NC2=CC=CC(=C2)C#C

DOS

IR

Vibrations