Geometry & MOs

Info

ID:	284379
PubChem CID:	104046202
Reduced:	O3N4C14H24 (1)
Stoich.:	A3B4C14D24 (1)
Weight, g/mol:	239.188529
ΔH_f, kcal/mol:	-111.56
Dipole, Da:	5.23
IP(EA), eV:	-9.59(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-cyclopropyl-2-[(2,3-dimethylcyclohexyl)amino]acetate

Drug info:

PubChemData

Smile

CCCOC1=NC(=NC(=N1)NC)OC2CC(OC(C2)C)C

DOS

IR

Vibrations