Geometry & MOs

Info

ID:	122787
PubChem CID:	50821416
Reduced:	SN2O2H20C22 (1)
Stoich.:	AB2C2D20E22 (1)
Weight, g/mol:	314.199428
ΔH_f, kcal/mol:	9.11
Dipole, Da:	2.88
IP(EA), eV:	-8.85(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(cyclopropanecarbonylamino)phenyl]-N-(3-methylbutyl)cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

C1CC1(C2=CC=C(C=C2)NC(=O)C3=CC=CS3)C(=O)NCC4=CC=CC=C4

DOS

IR

Vibrations