Geometry & MOs

Info

ID:	275101
PubChem CID:	103813812
Reduced:	ON5C12H21 (1)
Stoich.:	AB5C12D21 (1)
Weight, g/mol:	265.19026
ΔH_f, kcal/mol:	-16.78
Dipole, Da:	4.5
IP(EA), eV:	-9.02(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(aminomethyl)-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CCN1C=NN=C1CNC(=O)CC2CCNCC2

DOS

IR

Vibrations