Geometry & MOs

Info

ID:	249710
PubChem CID:	103091496
Reduced:	SN2C9H14 (1)
Stoich.:	AB2C9D14 (1)
Weight, g/mol:	151.110947
ΔH_f, kcal/mol:	20.22
Dipole, Da:	1.87
IP(EA), eV:	-8.92(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(3-methylimidazol-4-yl)but-3-en-2-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations