Geometry & MOs

Info

ID:	144436
PubChem CID:	53368212
Reduced:	ON5C17H23 (1)
Stoich.:	AB5C17D23 (1)
Weight, g/mol:	394.200491
ΔH_f, kcal/mol:	33.4
Dipole, Da:	10.12
IP(EA), eV:	-10.15(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(2-methoxyphenyl)piperazin-1-yl]-(3-methyl-6-propan-2-yl-[1,2]oxazolo[5,4-b]pyridin-4-yl)methanone

Drug info:

PubChemData

Smile

CC1=NN=NN1C2=CC=CC=C2C(=O)NC3CCCCCCC3

DOS

IR

Vibrations