Geometry & MOs

Info

ID:	249716
PubChem CID:	103091558
Reduced:	SN2C8H12 (1)
Stoich.:	AB2C8D12 (1)
Weight, g/mol:	187.099714
ΔH_f, kcal/mol:	32.69
Dipole, Da:	3.1
IP(EA), eV:	-9.01(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(1-benzofuran-3-yl)but-3-en-2-amine

Drug info:

PubChemData

Smile

CC1=C(SC=N1)/C=C/C(C)N

DOS

IR

Vibrations