Geometry & MOs

Info

ID:	292309
PubChem CID:	114916522
Reduced:	SN4C10H14 (1)
Stoich.:	AB4C10D14 (1)
Weight, g/mol:	236.109568
ΔH_f, kcal/mol:	51.26
Dipole, Da:	5.05
IP(EA), eV:	-8.26(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-2-[4-(2-methylpropyl)-1,2,4-triazol-3-yl]thiophen-3-amine

Drug info:

PubChemData

Smile

CC1=CSC(=C1N)C2=NN=CN2C(C)C

DOS

IR

Vibrations