Geometry & MOs

Info

ID:	362655
PubChem CID:	127309019
Reduced:	O3N6C17H28 (1)
Stoich.:	A3B6C17D28 (1)
Weight, g/mol:	316.164774
ΔH_f, kcal/mol:	-90.95
Dipole, Da:	4.21
IP(EA), eV:	-9.08(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-methylpyrimidin-4-yl)methyl]-2-(pyrazol-1-ylmethyl)morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)C(C)N2CCN(CC2)C(=O)NC(C)CN3CCCC3=O

DOS

IR

Vibrations