Geometry & MOs

Info

ID:	75760
PubChem CID:	48423945
Reduced:	O3N4C22H28 (1)
Stoich.:	A3B4C22D28 (1)
Weight, g/mol:	399.215806
ΔH_f, kcal/mol:	-88.33
Dipole, Da:	6.15
IP(EA), eV:	-9.21(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC(=O)NC(CC1=CC=CC=C1)C(=O)NC2CCN(CC2)CC3=CC=CC=N3

DOS

IR

Vibrations