Geometry & MOs

Info

ID:	260525
PubChem CID:	103194399
Reduced:	NOC5H7 (3)
Stoich.:	ABC5D7 (3)
Weight, g/mol:	291.194677
ΔH_f, kcal/mol:	-90.82
Dipole, Da:	3.59
IP(EA), eV:	-7.42(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-amino-5-propoxyphenyl)-N-methylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1CCCN(C1)C2=CC3=C(C=C2N)OCCO3

DOS

IR

Vibrations