Geometry & MOs

Info

ID:	285685
PubChem CID:	104118706
Reduced:	ON4C11H16 (1)
Stoich.:	AB4C11D16 (1)
Weight, g/mol:	198.030839
ΔH_f, kcal/mol:	35.19
Dipole, Da:	2.45
IP(EA), eV:	-9.13(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-chloropyrazol-1-yl)-1,3-oxazol-4-yl]methanamine

Drug info:

PubChemData

Smile

CC(C)(C)NCC1=COC(=N1)N2C=CC=N2

DOS

IR

Vibrations