Geometry & MOs

Info

ID:	196558
PubChem CID:	78847978
Reduced:	SN2O3C22H28 (1)
Stoich.:	AB2C3D22E28 (1)
Weight, g/mol:	432.216141
ΔH_f, kcal/mol:	-102.23
Dipole, Da:	2.43
IP(EA), eV:	-9.48(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-3-methyl-6-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=O)NCC3=CC=CC(=C3)C

DOS

IR

Vibrations