Geometry & MOs

Info

ID:	264438
PubChem CID:	103461762
Reduced:	O2N3C13H17 (1)
Stoich.:	A2B3C13D17 (1)
Weight, g/mol:	240.256549
ΔH_f, kcal/mol:	21.55
Dipole, Da:	11.34
IP(EA), eV:	-9.32(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2-dimethylbutyl)-2-methyl-N-propylpiperidin-4-amine

Drug info:

PubChemData

Smile

CCC(C)(C)CNC1=CC(=C(C=C1)[N+](=O)[O-])C#N

DOS

IR

Vibrations