Geometry & MOs

Info

ID:	249870
PubChem CID:	103092586
Reduced:	SN2C10H16 (1)
Stoich.:	AB2C10D16 (1)
Weight, g/mol:	273.01868
ΔH_f, kcal/mol:	32.84
Dipole, Da:	2.59
IP(EA), eV:	-9.11(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(4-bromothiophen-2-yl)-N-propylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCCNC(C)/C=C/C1=NC=CS1

DOS

IR

Vibrations