Geometry & MOs

Info

ID:	366352
PubChem CID:	127319817
Reduced:	SO3N4C18H22 (1)
Stoich.:	AB3C4D18E22 (1)
Weight, g/mol:	305.105879
ΔH_f, kcal/mol:	-65.47
Dipole, Da:	4.33
IP(EA), eV:	-9.14(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-cyclopropyltetrazol-5-yl)sulfanyl-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanone

Drug info:

PubChemData

Smile

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)N3CCN4C=CN=C4C3

DOS

IR

Vibrations