Geometry & MOs

Info

ID:	390751
PubChem CID:	135000763
Reduced:	N2O3C23H26 (1)
Stoich.:	A2B3C23D26 (1)
Weight, g/mol:	287.186084
ΔH_f, kcal/mol:	-91.07
Dipole, Da:	4.04
IP(EA), eV:	-8.06(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methyloctyl)-4-(trifluoromethyl)aniline

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC2=CC=CC=C2C1C3=CNC4=C3C=C(C=C4)OC

DOS

IR

Vibrations