Geometry & MOs

Info

ID:	187796
PubChem CID:	77625537
Reduced:	ON3C25H29 (1)
Stoich.:	AB3C25D29 (1)
Weight, g/mol:	567.203922
ΔH_f, kcal/mol:	11.16
Dipole, Da:	7.76
IP(EA), eV:	-8.87(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-[4-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-thiophen-2-ylphenyl]carbamoyl]phenyl]acetic acid

Drug info:

PubChemData

Smile

CC(C)C1=NC=CN1C2CCC(C2)CC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations