Geometry & MOs

Info

ID:	75847
PubChem CID:	48424062
Reduced:	N2O6C21H26 (1)
Stoich.:	A2B6C21D26 (1)
Weight, g/mol:	321.168856
ΔH_f, kcal/mol:	-204.81
Dipole, Da:	7.65
IP(EA), eV:	-9.01(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=C(C(=C(C=C1)CNC(=O)C(CC2=CC=CC=C2)NC(=O)OC)OC)OC

DOS

IR

Vibrations