Geometry & MOs

Info

ID:	186464
PubChem CID:	77437581
Reduced:	PO3C30H49 (1)
Stoich.:	AB3C30D49 (1)
Weight, g/mol:	223.132077
ΔH_f, kcal/mol:	-205.57
Dipole, Da:	5.21
IP(EA), eV:	-9.5(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-tert-butyl-1,2-oxazol-5-yl)azetidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1CCC2(C1C3CCC4C5(CCC(=O)C(C5CCC4(C3(CC2)C)C)(C)C)C)C(=O)OP

DOS

IR

Vibrations