Geometry & MOs

Info

ID:	21568
PubChem CID:	588937
Reduced:	NO3C24H37 (1)
Stoich.:	AB3C24D37 (1)
Weight, g/mol:	387.277344
ΔH_f, kcal/mol:	-150.89
Dipole, Da:	4.46
IP(EA), eV:	-9.19(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl) 3-[(2-hydroxy-2-phenylethyl)amino]hexanoate

Drug info:

PubChemData

Smile

CCCC(CC(=O)OC1CC2CCC1(C2(C)C)C)NCC(C3=CC=CC=C3)O

DOS

IR

Vibrations