Geometry & MOs

Info

ID:	300510
PubChem CID:	121360356
Reduced:	NOH17C24 (1)
Stoich.:	ABC17D24 (1)
Weight, g/mol:	621.26863
ΔH_f, kcal/mol:	62.11
Dipole, Da:	2.75
IP(EA), eV:	-8.09(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[[2-hydroxy-4-[[4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoyl]amino]-3-propan-2-yloxybenzoyl]amino]-3-propan-2-yloxybenzoate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC=CC(=C4)C5=CC=CC=C5O

DOS

IR

Vibrations