Geometry & MOs

Info

ID:	361715
PubChem CID:	127304530
Reduced:	SO2N7C15H23 (1)
Stoich.:	AB2C7D15E23 (1)
Weight, g/mol:	376.247441
ΔH_f, kcal/mol:	15.07
Dipole, Da:	4.56
IP(EA), eV:	-9.05(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[2-[(3,5-dimethylpyrazol-1-yl)methyl]morpholin-4-yl]-1-oxopropan-2-yl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NN1CC2CN(CCO2)C(=O)CCSC3=NN=NN3C)C

DOS

IR

Vibrations