Geometry & MOs

Info

ID:	127436
PubChem CID:	51002257
Reduced:	NO3C24H33 (1)
Stoich.:	AB3C24D33 (1)
Weight, g/mol:	383.246044
ΔH_f, kcal/mol:	-126.16
Dipole, Da:	3.6
IP(EA), eV:	-8.62(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[6-(4-tert-butylcyclohexyl)oxynaphthalen-2-yl]methyl-methylamino]acetic acid

Drug info:

PubChemData

Smile

CC(C)(C)C1CCC(CC1)OC2=CC3=C(C=C2)C=C(C=C3)N(C)CCC(=O)O

DOS

IR

Vibrations