Geometry & MOs

Info

ID:	131988
PubChem CID:	51287073
Reduced:	OSN5H13C18 (1)
Stoich.:	ABC5D13E18 (1)
Weight, g/mol:	336.10046
ΔH_f, kcal/mol:	123.09
Dipole, Da:	6.96
IP(EA), eV:	-9.22(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-carbamoyl-3-[1-[(4-methoxyphenyl)methyl]tetrazol-5-yl]sulfanylpropanamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C2=CC=CS2)NC(=O)C3=CC(=CC=C3)N4C=NN=N4

DOS

IR

Vibrations