Geometry & MOs

Info

ID:	291744
PubChem CID:	113464598
Reduced:	N2O2C13H16 (1)
Stoich.:	A2B2C13D16 (1)
Weight, g/mol:	239.236148
ΔH_f, kcal/mol:	-10.89
Dipole, Da:	4.84
IP(EA), eV:	-8.36(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(aminomethyl)-N-[(E)-pent-3-enyl]-1-propan-2-ylpiperidin-4-amine

Drug info:

PubChemData

Smile

CC#CCNCC(=O)NC1=CC=CC=C1OC

DOS

IR

Vibrations