Geometry & MOs

Info

ID:	194242
PubChem CID:	78503455
Reduced:	FOSN5C17H22 (1)
Stoich.:	ABCD5E17F22 (1)
Weight, g/mol:	347.085224
ΔH_f, kcal/mol:	-9.59
Dipole, Da:	1.71
IP(EA), eV:	-9.4(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(3-fluorophenyl)tetrazol-5-yl]sulfanyl-N-(furan-2-ylmethyl)propanamide

Drug info:

PubChemData

Smile

CC1CCCC(N1C(=O)C(C)SC2=NN=NN2C3=CC(=CC=C3)F)C

DOS

IR

Vibrations