Geometry & MOs

Info

ID:	221302
PubChem CID:	85267550
Reduced:	NSO2C23H39 (1)
Stoich.:	ABC2D23E39 (1)
Weight, g/mol:	394.210387
ΔH_f, kcal/mol:	-123.46
Dipole, Da:	5.66
IP(EA), eV:	-9.43(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(oxiran-2-yl)ethyl]phenoxy]ethyl N,N-dimethylcarbamate

Drug info:

PubChemData

Smile

CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)NCCC=CC(C)(C)C)C(C)C

DOS

IR

Vibrations