Geometry & MOs

Info

ID:	332141
PubChem CID:	127250427
Reduced:	ON6C22H26 (1)
Stoich.:	AB6C22D26 (1)
Weight, g/mol:	418.236876
ΔH_f, kcal/mol:	61.81
Dipole, Da:	2.47
IP(EA), eV:	-8.13(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[6-[4-[(4-methoxy-2,3,6-trimethylphenyl)methyl]morpholin-2-yl]pyridin-3-yl]pyridin-2-amine

Drug info:

PubChemData

Smile

CN(C)C1=C(C=CC=N1)CN2CCOC(C2)C3=NC=C(C=C3)C4=CN=C(C=C4)N

DOS

IR

Vibrations