Geometry & MOs

Info

ID:	350010
PubChem CID:	127276883
Reduced:	N3O3C22H31 (1)
Stoich.:	A3B3C22D31 (1)
Weight, g/mol:	377.173942
ΔH_f, kcal/mol:	-121.47
Dipole, Da:	2.33
IP(EA), eV:	-8.75(0.35)
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)-[2-(2-methoxyphenyl)pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C2CCCN2C(=O)C3CCCN(C3)C(=O)N4CCCC4

DOS

IR

Vibrations