Geometry & MOs

Info

ID:	417615
PubChem CID:	135102243
Reduced:	SO3N4C19H24 (1)
Stoich.:	AB3C4D19E24 (1)
Weight, g/mol:	268.132411
ΔH_f, kcal/mol:	-95.4
Dipole, Da:	5.33
IP(EA), eV:	-8.44(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-(1,2-oxazol-3-yl)-N-[(2-pyrazol-1-ylphenyl)methyl]methanamine

Drug info:

PubChemData

Smile

CC1=CC(=C(N=C1C)NC2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C(=O)N

DOS

IR

Vibrations