Geometry & MOs

Info

ID:	61237
PubChem CID:	26707262
Reduced:	N3O3C25H27 (1)
Stoich.:	A3B3C25D27 (1)
Weight, g/mol:	395.184506
ΔH_f, kcal/mol:	-96.17
Dipole, Da:	6.74
IP(EA), eV:	-8.5(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-[4-[[2-(cyclopentylcarbamoyl)phenyl]carbamoyl]phenyl]carbamate

Drug info:

PubChemData

Smile

CC(=O)N1C=CC2=CC=CC=C2[C@@H]1CC(=O)NC3=CC=CC=C3C(=O)NC4CCCC4

DOS

IR

Vibrations