Geometry & MOs

Info

ID:	249953
PubChem CID:	103093109
Reduced:	NO2C16H25 (1)
Stoich.:	AB2C16D25 (1)
Weight, g/mol:	319.05718
ΔH_f, kcal/mol:	-66.47
Dipole, Da:	1.69
IP(EA), eV:	-8.1(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-[5-(4-bromophenyl)furan-2-yl]-N,3-dimethylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCCOC1=C(C=CC(=C1)/C=C(/C)\C(C)NC)OC

DOS

IR

Vibrations