Geometry & MOs

Info

ID:	138962
PubChem CID:	52448814
Reduced:	NO5C18H23 (1)
Stoich.:	AB5C18D23 (1)
Weight, g/mol:	305.131031
ΔH_f, kcal/mol:	-200.92
Dipole, Da:	5.42
IP(EA), eV:	-9.9(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-butyl-2-(1-methyltetrazol-5-yl)sulfanyl-2-phenylacetamide

Drug info:

PubChemData

Smile

CCOCCOC(=O)[C@@H](CC(C)C)N1C(=O)C2=CC=CC=C2C1=O

DOS

IR

Vibrations