Geometry & MOs

Info

ID:	200003
PubChem CID:	79330359
Reduced:	ClFNC14H19 (1)
Stoich.:	ABCD14E19 (1)
Weight, g/mol:	257.139134
ΔH_f, kcal/mol:	-46.48
Dipole, Da:	4.16
IP(EA), eV:	-9.13(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-propan-2-yl-2-[(3,4,5-trifluorophenyl)methylidene]butan-1-amine

Drug info:

PubChemData

Smile

CCC(=CC1=CC(=C(C=C1)Cl)F)CNC(C)C

DOS

IR

Vibrations