Geometry & MOs

Info

ID:	331956
PubChem CID:	127250242
Reduced:	ON4C22H26 (1)
Stoich.:	AB4C22D26 (1)
Weight, g/mol:	376.226312
ΔH_f, kcal/mol:	46.6
Dipole, Da:	3.28
IP(EA), eV:	-8.61(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1-ethylpyrazol-4-yl)methyl]-2-[5-[(4-methylphenyl)methyl]pyridin-2-yl]morpholine

Drug info:

PubChemData

Smile

CCN1C=C(C=N1)CN2CCOC(C2)C3=NC=C(C=C3)CC4=CC=CC=C4

DOS

IR

Vibrations