Geometry & MOs

Info

ID:	332330
PubChem CID:	127250616
Reduced:	N3O3C27H31 (1)
Stoich.:	A3B3C27D31 (1)
Weight, g/mol:	445.236542
ΔH_f, kcal/mol:	-65.87
Dipole, Da:	4.09
IP(EA), eV:	-8.38(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1CN2CCOC(C2)C3=CC=CC(=N3)C4=CC(=CC=C4)C(=O)N)C)C)OC

DOS

IR

Vibrations