Geometry & MOs

Info

ID:	254240
PubChem CID:	103123630
Reduced:	ON5H9C10 (1)
Stoich.:	AB5C9D10 (1)
Weight, g/mol:	192.101111
ΔH_f, kcal/mol:	76.02
Dipole, Da:	0.42
IP(EA), eV:	-8.87(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-[5-(1-methylpyrazol-3-yl)-1,3-oxazol-4-yl]methanamine

Drug info:

PubChemData

Smile

C1=CN2C(=C(C=N2)C3=C(N=CO3)CN)C=N1

DOS

IR

Vibrations