Geometry & MOs

Info

ID:	363265
PubChem CID:	127310406
Reduced:	SO2N5C19H29 (1)
Stoich.:	AB2C5D19E29 (1)
Weight, g/mol:	349.157246
ΔH_f, kcal/mol:	-44.47
Dipole, Da:	6.31
IP(EA), eV:	-8.99(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CC2CN(CCO2)C(=O)NC(C)C3=NC(=CS3)C(C)(C)C

DOS

IR

Vibrations