Geometry & MOs

Info

ID:	248886
PubChem CID:	103085265
Reduced:	OSN5C13H19 (1)
Stoich.:	ABC5D13E19 (1)
Weight, g/mol:	183.148396
ΔH_f, kcal/mol:	56.89
Dipole, Da:	4.41
IP(EA), eV:	-8.8(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-butyltetrazol-5-yl)-N-methylethanamine

Drug info:

PubChemData

Smile

CC(C1=NN=NN1C2=CC(=CC=C2)SC)NCCOC

DOS

IR

Vibrations