Geometry & MOs

Info

ID:	200651
PubChem CID:	79422491
Reduced:	N3C18H25 (1)
Stoich.:	A3B18C25 (1)
Weight, g/mol:	293.139134
ΔH_f, kcal/mol:	34.43
Dipole, Da:	2.08
IP(EA), eV:	-8.99(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methylphenyl)-3-[3-(trifluoromethyl)phenyl]propan-1-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(CC2=NN(C=C2)C3CCCC3)CN

DOS

IR

Vibrations