Geometry & MOs

Info

ID:	194554
PubChem CID:	78555100
Reduced:	NO4C24H31 (1)
Stoich.:	AB4C24D31 (1)
Weight, g/mol:	401.220223
ΔH_f, kcal/mol:	-156.66
Dipole, Da:	2.19
IP(EA), eV:	-9.06(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[1-(1-adamantyl)ethylamino]-2-oxoethyl] 2-(2-methoxyphenoxy)acetate

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)OCC(=O)OCC(=O)NC(C)C2=CC=C(C=C2)CC(C)C)C

DOS

IR

Vibrations