Geometry & MOs

Info

ID:	211114
PubChem CID:	80898785
Reduced:	ON5C15H21 (1)
Stoich.:	AB5C15D21 (1)
Weight, g/mol:	280.164774
ΔH_f, kcal/mol:	20.23
Dipole, Da:	5.63
IP(EA), eV:	-8.6(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyclohexylethyl)-6-hydrazinyl-5-nitropyrimidin-4-amine

Drug info:

PubChemData

Smile

CCOC1CCN(CC1)C2=NC(=NC3=CC=CC=C32)NN

DOS

IR

Vibrations