Geometry & MOs

Info

ID:	364989
PubChem CID:	127316639
Reduced:	SN2O3C18H26 (1)
Stoich.:	AB2C3D18E26 (1)
Weight, g/mol:	375.194677
ΔH_f, kcal/mol:	-118.49
Dipole, Da:	7.49
IP(EA), eV:	-9.5(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1(CCCN(C1)C(=O)CN2CCS(=O)(=O)CC2)C3=CC=CC=C3

DOS

IR

Vibrations