Geometry & MOs

Info

ID:	75732
PubChem CID:	48423908
Reduced:	ClNSO2C18H20 (1)
Stoich.:	ABCD2E18F20 (1)
Weight, g/mol:	240.147393
ΔH_f, kcal/mol:	-34.67
Dipole, Da:	3.86
IP(EA), eV:	-9.25(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(cyclopropylmethoxy)propanoyl]pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NC(C1=CC=C(C=C1)Cl)C2=CC=CS2)OCC3CC3

DOS

IR

Vibrations