Geometry & MOs

Info

ID:	249694
PubChem CID:	103091406
Reduced:	NC7H10 (2)
Stoich.:	AB7C10 (2)
Weight, g/mol:	197.060742
ΔH_f, kcal/mol:	19.94
Dipole, Da:	4.02
IP(EA), eV:	-7.92(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(E)-3-aminobut-1-enyl]-2-chlorophenol

Drug info:

PubChemData

Smile

CC(/C=C/C1=CC2=C(C=C1)N(CCC2)C)N

DOS

IR

Vibrations