Geometry & MOs

Info

ID:	294617
PubChem CID:	117474197
Reduced:	ClNOC17H24 (1)
Stoich.:	ABCD17E24 (1)
Weight, g/mol:	293.02268
ΔH_f, kcal/mol:	-70.59
Dipole, Da:	3.05
IP(EA), eV:	-8.67(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-bromo-2,4-difluoro-3-methoxyphenyl)butan-1-amine

Drug info:

PubChemData

Smile

CC1=C2CCCCC2=C(C(=C1CC3CCNCC3)O)Cl

DOS

IR

Vibrations