Geometry & MOs

Info

ID:	362004
PubChem CID:	127305350
Reduced:	SN4O4C18H22 (1)
Stoich.:	AB4C4D18E22 (1)
Weight, g/mol:	277.128723
ΔH_f, kcal/mol:	-95.13
Dipole, Da:	6.49
IP(EA), eV:	-9.04(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(pyrazol-1-ylmethyl)morpholin-4-yl]-2-(tetrazol-1-yl)ethanone

Drug info:

PubChemData

Smile

C1CN(S(=O)(=O)C1)C2=CC=CC(=C2)C(=O)N3CCOC(C3)CN4C=CC=N4

DOS

IR

Vibrations