Geometry & MOs

Info

ID:	61679
PubChem CID:	26711762
Reduced:	O2S2N3C22H25 (1)
Stoich.:	A2B2C3D22E25 (1)
Weight, g/mol:	325.144471
ΔH_f, kcal/mol:	-49.02
Dipole, Da:	6.08
IP(EA), eV:	-8.58(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-cycloheptyl-4-ethoxy-5-methoxybenzamide

Drug info:

PubChemData

Smile

C1CCCC(CC1)NC(=O)CSCC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

DOS

IR

Vibrations