Geometry & MOs

Info

ID:	249122
PubChem CID:	103086963
Reduced:	S2N5C9H17 (1)
Stoich.:	A2B5C9D17 (1)
Weight, g/mol:	239.17461
ΔH_f, kcal/mol:	64.37
Dipole, Da:	7.18
IP(EA), eV:	-8.98(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-1-[1-(4-methyloxan-4-yl)tetrazol-5-yl]ethanamine

Drug info:

PubChemData

Smile

CC(C1=NN=NN1CC2CSCCS2)NC

DOS

IR

Vibrations