Geometry & MOs

Info

ID:	74753
PubChem CID:	48422408
Reduced:	SN3O5C18H27 (1)
Stoich.:	AB3C5D18E27 (1)
Weight, g/mol:	400.199822
ΔH_f, kcal/mol:	-158.96
Dipole, Da:	6.53
IP(EA), eV:	-9.64(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[(4-ethoxy-3-methoxyphenyl)methyl-methylamino]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC(=O)C(C)OCC2CC2

DOS

IR

Vibrations