Geometry & MOs

Info

ID:	146331
PubChem CID:	53671360
Reduced:	N2C8H13 (2)
Stoich.:	A2B8C13 (2)
Weight, g/mol:	215.092184
ΔH_f, kcal/mol:	29.67
Dipole, Da:	2.5
IP(EA), eV:	-8.76(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-but-2-enyl-3-(trifluoromethyl)aniline

Drug info:

PubChemData

Smile

CCCCN(CN1CC2=CC=CC=C2C1CC)C(=N)N

DOS

IR

Vibrations