Geometry & MOs

Info

ID:	416406
PubChem CID:	135089419
Reduced:	ON2C11H14 (2)
Stoich.:	AB2C11D14 (2)
Weight, g/mol:	330.169191
ΔH_f, kcal/mol:	-56.28
Dipole, Da:	2.47
IP(EA), eV:	-7.87(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-acetamidophenyl)methyl]-2-[methyl-[(3-methyl-1,2-oxazol-5-yl)methyl]amino]acetamide

Drug info:

PubChemData

Smile

CC1=C2C(=C(NC2=C(C=C1)C)C)CC(=O)N3C[C@H]([C@H](C3)O)CC4=NNC(=C4)C

DOS

IR

Vibrations