Geometry & MOs

Info

ID:	280750
PubChem CID:	103851087
Reduced:	NSO3C11H17 (1)
Stoich.:	ABC3D11E17 (1)
Weight, g/mol:	291.133139
ΔH_f, kcal/mol:	-115.72
Dipole, Da:	4.29
IP(EA), eV:	-9.21(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxy-1-methoxybutan-2-yl)-4-(2H-tetrazol-5-yl)benzamide

Drug info:

PubChemData

Smile

COCC(CCO)NC(=O)CC1=CSC=C1

DOS

IR

Vibrations