Geometry & MOs

Info

ID:	249895
PubChem CID:	103092724
Reduced:	ClNSC11H16 (1)
Stoich.:	ABCD11E16 (1)
Weight, g/mol:	195.108171
ΔH_f, kcal/mol:	20.18
Dipole, Da:	2.47
IP(EA), eV:	-9.02(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-propyl-4-thiophen-2-ylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCCNC(C)/C=C/C1=CC=C(S1)Cl

DOS

IR

Vibrations