Geometry & MOs

Info

ID:	261824
PubChem CID:	103253261
Reduced:	NO3C16H19 (1)
Stoich.:	AB3C16D19 (1)
Weight, g/mol:	269.199094
ΔH_f, kcal/mol:	-85.38
Dipole, Da:	8.19
IP(EA), eV:	-9.3(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-cyclopropyl-2-[(4-ethyl-1-hydroxycyclohexyl)methylamino]acetate

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1CNCC2=C(OC(=C2)C(=O)O)C

DOS

IR

Vibrations