Geometry & MOs

Info

ID:	342030
PubChem CID:	127264743
Reduced:	NO3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	246.149891
ΔH_f, kcal/mol:	-106.47
Dipole, Da:	4.26
IP(EA), eV:	-9.96(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-(piperidin-3-ylmethyl)pent-2-enamide;hydrochloride

Drug info:

PubChemData

Smile

CCC=C(C)C(=O)N[C@@H](C1=CC=CC=C1)C(=O)O

DOS

IR

Vibrations