Geometry & MOs

Info

ID:	240755
PubChem CID:	93617347
Reduced:	ClNSO4C11H14 (1)
Stoich.:	ABCD4E11F14 (1)
Weight, g/mol:	349.120861
ΔH_f, kcal/mol:	-163.45
Dipole, Da:	7.28
IP(EA), eV:	-9.35(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(1-benzyltetrazol-5-yl)methylsulfonyl]-N-cyclopropylpropanamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)N)S(=O)(=O)CC1=C(C=CC(=C1)Cl)OC

DOS

IR

Vibrations