Geometry & MOs

Info

ID:	249183
PubChem CID:	103087508
Reduced:	NSC17H29 (1)
Stoich.:	ABC17D29 (1)
Weight, g/mol:	291.110456
ΔH_f, kcal/mol:	-24.37
Dipole, Da:	3.26
IP(EA), eV:	-7.99(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(difluoromethoxy)-5-methoxy-N-(4-methylsulfanylbutyl)aniline

Drug info:

PubChemData

Smile

CC(C)C1=CC(=C(C=C1)NCCCCSC)C(C)C

DOS

IR

Vibrations