Geometry & MOs

Info

ID:	331617
PubChem CID:	127249700
Reduced:	O3N4C15H18 (1)
Stoich.:	A3B4C15D18 (1)
Weight, g/mol:	425.152161
ΔH_f, kcal/mol:	-39.8
Dipole, Da:	3.65
IP(EA), eV:	-8.95(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[6-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]pyridin-2-yl]morpholin-4-yl]-(3-methoxyphenyl)methanone

Drug info:

PubChemData

Smile

CC1=CC(=NO1)NC2=CC=CC(=N2)C3CN(CCO3)C(=O)C

DOS

IR

Vibrations