Geometry & MOs

Info

ID:	249848
PubChem CID:	103092495
Reduced:	ON2C13H18 (1)
Stoich.:	AB2C13D18 (1)
Weight, g/mol:	292.96406
ΔH_f, kcal/mol:	-18.69
Dipole, Da:	4.2
IP(EA), eV:	-9.08(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(4-bromo-5-chlorothiophen-2-yl)-N-ethylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCNC(C)/C=C/C1=CC=C(C=C1)C(=O)N

DOS

IR

Vibrations