Geometry & MOs

Info

ID:	261847
PubChem CID:	103255183
Reduced:	NO3C10H17 (1)
Stoich.:	AB3C10D17 (1)
Weight, g/mol:	271.214744
ΔH_f, kcal/mol:	-140.76
Dipole, Da:	4.7
IP(EA), eV:	-8.99(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[2-(hydroxymethyl)cyclohexyl]methylamino]hexanoate

Drug info:

PubChemData

Smile

COC(=O)/C=C/NCC1CCCC1O

DOS

IR

Vibrations