Geometry & MOs

Info

ID:	290048
PubChem CID:	104403093
Reduced:	O3N4C12H18 (1)
Stoich.:	A3B4C12D18 (1)
Weight, g/mol:	285.205242
ΔH_f, kcal/mol:	-104.81
Dipole, Da:	6.58
IP(EA), eV:	-9.43(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-[1-(2-methoxyethylamino)-1-oxopropan-2-yl]-4-methylcyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NCCOC)NC(=O)C1=NC=CC(=C1)N

DOS

IR

Vibrations