Geometry & MOs

Info

ID:	305473
PubChem CID:	124955872
Reduced:	O3N5C18H21 (1)
Stoich.:	A3B5C18D21 (1)
Weight, g/mol:	376.226312
ΔH_f, kcal/mol:	-46.35
Dipole, Da:	6.42
IP(EA), eV:	-9.49(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-4-[(1,3-dimethylpyrazol-4-yl)methyl]-2-[6-[(2-methylphenyl)methyl]pyridin-2-yl]morpholine

Drug info:

PubChemData

Smile

C[C@]1(CN(CCO1)C(=O)C2=CN=C(C=C2)C3=CN=CN=C3)C(=O)N(C)C

DOS

IR

Vibrations