Geometry & MOs

Info

ID:	156462
PubChem CID:	56370728
Reduced:	ClO2N3C21H30 (1)
Stoich.:	AB2C3D21E30 (1)
Weight, g/mol:	362.202799
ΔH_f, kcal/mol:	-99.04
Dipole, Da:	5.4
IP(EA), eV:	-8.75(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cycloheptylpyrrolidin-3-yl)-4-(5-methylthiophen-2-yl)-4-oxobutanamide

Drug info:

PubChemData

Smile

C1CCCC(CC1)N2CCC(C2)NC(=O)CCNC(=O)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations