Geometry & MOs

Info

ID:	270704
PubChem CID:	103637759
Reduced:	N6C13H20 (1)
Stoich.:	A6B13C20 (1)
Weight, g/mol:	253.153875
ΔH_f, kcal/mol:	89.0
Dipole, Da:	2.08
IP(EA), eV:	-8.85(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-cyclopropyl-N'-ethyl-N-(3-methyl-5-nitroimidazol-4-yl)ethane-1,2-diamine

Drug info:

PubChemData

Smile

CCN(CCNC1=C2C=NN(C2=NC=N1)C)C3CC3

DOS

IR

Vibrations