Geometry & MOs

Info

ID:	348768
PubChem CID:	127273879
Reduced:	O2N6C21H30 (1)
Stoich.:	A2B6C21D30 (1)
Weight, g/mol:	384.227374
ΔH_f, kcal/mol:	-38.57
Dipole, Da:	1.48
IP(EA), eV:	-9.02(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)urea

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)CC2=CC=CC=C2NC(=O)NC3CCC4=NC(=NN4C3)C

DOS

IR

Vibrations