Geometry & MOs

Info

ID:	247151
PubChem CID:	103068234
Reduced:	SN4C15H22 (1)
Stoich.:	AB4C15D22 (1)
Weight, g/mol:	275.145619
ΔH_f, kcal/mol:	107.91
Dipole, Da:	8.56
IP(EA), eV:	-7.98(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1H-benzimidazol-2-ylsulfanylmethyl)-N-tert-butylprop-2-en-1-amine

Drug info:

PubChemData

Smile

C=C(CNC1CC1)CSC2=NN=C(N2C3CC3)C4CC4

DOS

IR

Vibrations