Geometry & MOs

Info

ID:	241097
PubChem CID:	93621810
Reduced:	N2O2C19H26 (1)
Stoich.:	A2B2C19D26 (1)
Weight, g/mol:	314.199428
ΔH_f, kcal/mol:	-101.6
Dipole, Da:	1.98
IP(EA), eV:	-9.27(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-1-propanoyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)N1CCC[C@H](C1)C(=O)N[C@@H]2CCCC3=CC=CC=C23

DOS

IR

Vibrations