Geometry & MOs

Info

ID:	243431
PubChem CID:	99222785
Reduced:	O3N4C22H24 (1)
Stoich.:	A3B4C22D24 (1)
Weight, g/mol:	392.184841
ΔH_f, kcal/mol:	-37.13
Dipole, Da:	8.69
IP(EA), eV:	-9.59(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-1-(cyclopentylamino)-1-oxopropan-2-yl]-3-methyl-6-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)N[C@@H](C)C(=O)NC4CCCC4

DOS

IR

Vibrations