Geometry & MOs

Info

ID:	332123
PubChem CID:	127250409
Reduced:	N3O3C27H29 (1)
Stoich.:	A3B3C27D29 (1)
Weight, g/mol:	429.216475
ΔH_f, kcal/mol:	-59.65
Dipole, Da:	6.16
IP(EA), eV:	-8.45(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[6-[4-[(6-methoxy-1-methylindol-3-yl)methyl]morpholin-2-yl]pyridin-3-yl]pyridin-2-amine

Drug info:

PubChemData

Smile

CC1(CC2=C(O1)C=CC(=C2)CN3CCOC(C3)C4=NC=C(C=C4)C5=CC(=CC=C5)C(=O)N)C

DOS

IR

Vibrations