Geometry & MOs

Info

ID:	60793
PubChem CID:	26702268
Reduced:	ClN2O5H17C23 (1)
Stoich.:	AB2C5D17E23 (1)
Weight, g/mol:	485.252586
ΔH_f, kcal/mol:	-126.55
Dipole, Da:	5.66
IP(EA), eV:	-8.96(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[4-[(2,5-diethoxy-4-morpholin-4-ylphenyl)carbamoyl]phenyl]carbamate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N(C(=O)O2)CCC(=O)OC3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations