Geometry & MOs

Info

ID:	277871
PubChem CID:	103831417
Reduced:	ON2C11H22 (1)
Stoich.:	AB2C11D22 (1)
Weight, g/mol:	287.163377
ΔH_f, kcal/mol:	-60.99
Dipole, Da:	2.68
IP(EA), eV:	-9.56(1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-(2-cyclopropyl-1,3-benzoxazol-5-yl)hexanamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)NCC1CC1C)N

DOS

IR

Vibrations