Geometry & MOs

Info

ID:	363274
PubChem CID:	127310429
Reduced:	OSN3C7H10 (2)
Stoich.:	ABC3D7E10 (2)
Weight, g/mol:	356.221226
ΔH_f, kcal/mol:	1.01
Dipole, Da:	5.32
IP(EA), eV:	-8.44(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-tert-butylphenyl)-2-[(4-methylpyrazol-1-yl)methyl]morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CCSC1=NN=C(S1)NC(=O)N2CCOC(C2)CN3C=C(C=N3)C

DOS

IR

Vibrations