Geometry & MOs

Info

ID:	234385
PubChem CID:	92298308
Reduced:	ClN2C18H27 (1)
Stoich.:	AB2C18D27 (1)
Weight, g/mol:	387.277344
ΔH_f, kcal/mol:	8.09
Dipole, Da:	6.17
IP(EA), eV:	-8.74(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(diethylamino)ethyl (2S)-2-[[(2S)-oxolan-2-yl]methyl]-3-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]propanoate

Drug info:

PubChemData

Smile

CCN(CC)CCC[C@@](C#N)(C1=CC=CC=C1Cl)C(C)C

DOS

IR

Vibrations