Geometry & MOs

Info

ID:	240282
PubChem CID:	93576759
Reduced:	OSN2C12H18 (1)
Stoich.:	ABC2D12E18 (1)
Weight, g/mol:	236.152478
ΔH_f, kcal/mol:	-39.47
Dipole, Da:	2.27
IP(EA), eV:	-8.34(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-aminophenoxy)-N-[(2R)-butan-2-yl]-N-methylacetamide

Drug info:

PubChemData

Smile

CC[C@H]1CCCCN1C(=O)C2=C(C=CS2)N

DOS

IR

Vibrations