Geometry & MOs

Info

ID:	369301
PubChem CID:	127332298
Reduced:	SO3N4C18H26 (1)
Stoich.:	AB3C4D18E26 (1)
Weight, g/mol:	371.199111
ΔH_f, kcal/mol:	-84.6
Dipole, Da:	4.59
IP(EA), eV:	-8.42(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-morpholin-4-ylsulfonyl-N-[(1-propylpyrazol-4-yl)methyl]piperidin-4-amine

Drug info:

PubChemData

Smile

C1CN(CCC1NCC2=CC=CC3=C2NC=C3)S(=O)(=O)N4CCOCC4

DOS

IR

Vibrations