Geometry & MOs

Info

ID:	448342
PubChem CID:	135290247
Reduced:	NC14H17 (1)
Stoich.:	AB14C17 (1)
Weight, g/mol:	216.126263
ΔH_f, kcal/mol:	36.21
Dipole, Da:	1.69
IP(EA), eV:	-9.02(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(4-phenylpiperazin-1-yl)prop-2-enal

Drug info:

PubChemData

Smile

CCC1(CC=C(C=C1)C2=CC=CC=C2)N

DOS

IR

Vibrations