Geometry & MOs

Info

ID:	364992
PubChem CID:	127316642
Reduced:	O2N5C20H23 (1)
Stoich.:	A2B5C20D23 (1)
Weight, g/mol:	363.194677
ΔH_f, kcal/mol:	-11.57
Dipole, Da:	1.27
IP(EA), eV:	-9.4(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1(CCCN(C1)C(=O)CN2C=NC3=C(C2=O)C=NN3C)C4=CC=CC=C4

DOS

IR

Vibrations