Geometry & MOs

Info

ID:	273597
PubChem CID:	103771440
Reduced:	NF2O2C13H17 (1)
Stoich.:	AB2C2D13E17 (1)
Weight, g/mol:	289.153875
ΔH_f, kcal/mol:	-180.77
Dipole, Da:	2.21
IP(EA), eV:	-10.03(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)C1=CC(=C(C=C1)F)F)O

DOS

IR

Vibrations