Geometry & MOs

Info

ID:	262295
PubChem CID:	103282740
Reduced:	O4C13H20 (1)
Stoich.:	A4B13C20 (1)
Weight, g/mol:	243.143471
ΔH_f, kcal/mol:	-166.88
Dipole, Da:	6.49
IP(EA), eV:	-9.84(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(difluoromethyl)-4-(2-methylpentoxy)aniline

Drug info:

PubChemData

Smile

CCCC(C)COCC1=CC(=C(O1)C(=O)O)C

DOS

IR

Vibrations