Geometry & MOs

Info

ID:	204657
PubChem CID:	79994548
Reduced:	O3N4C11H16 (1)
Stoich.:	A3B4C11D16 (1)
Weight, g/mol:	199.168462
ΔH_f, kcal/mol:	-31.38
Dipole, Da:	6.41
IP(EA), eV:	-9.56(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-5-methyl-N-propylpiperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CC(CN(C1)C(=O)C2=CC=C(N2)[N+](=O)[O-])N

DOS

IR

Vibrations