Geometry & MOs

Info

ID:	132088
PubChem CID:	51304348
Reduced:	ON6C14H16 (1)
Stoich.:	AB6C14D16 (1)
Weight, g/mol:	365.078031
ΔH_f, kcal/mol:	109.84
Dipole, Da:	10.34
IP(EA), eV:	-9.08(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OCCN(C)C2=NN3C(=NN=N3)C=C2

DOS

IR

Vibrations