Geometry & MOs

Info

ID:	362555
PubChem CID:	127308210
Reduced:	O2N6C13H18 (1)
Stoich.:	A2B6C13D18 (1)
Weight, g/mol:	371.19574
ΔH_f, kcal/mol:	5.56
Dipole, Da:	3.23
IP(EA), eV:	-8.78(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3,5-dimethylpyrazol-1-yl)methyl]-N-[4-(methylcarbamoyl)phenyl]morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CN1C=C(C=N1)NC(=O)N2CCOC(C2)CN3C=CC=N3

DOS

IR

Vibrations