Geometry & MOs

Info

ID:	89400
PubChem CID:	49961434
Reduced:	SN2O4C12H18 (1)
Stoich.:	AB2C4D12E18 (1)
Weight, g/mol:	356.173607
ΔH_f, kcal/mol:	-152.44
Dipole, Da:	7.75
IP(EA), eV:	-9.16(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-benzyl-N-[2-[benzyl(methoxycarbonyl)amino]ethyl]carbamate

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC(=O)OC

DOS

IR

Vibrations