Geometry & MOs

Info

ID:	342611
PubChem CID:	127265771
Reduced:	O2N4C15H18 (1)
Stoich.:	A2B4C15D18 (1)
Weight, g/mol:	224.188863
ΔH_f, kcal/mol:	-1.16
Dipole, Da:	8.06
IP(EA), eV:	-9.03(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(hex-3-enylamino)cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)CN1C(=C(C(=N1)C)C=CC2=CN=NC=C2)C

DOS

IR

Vibrations