Geometry & MOs

Info

ID:	238288
PubChem CID:	92729945
Reduced:	N3O3C23H25 (1)
Stoich.:	A3B3C23D25 (1)
Weight, g/mol:	315.158292
ΔH_f, kcal/mol:	-72.49
Dipole, Da:	4.6
IP(EA), eV:	-9.25(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-(4-acetamidobenzoyl)-N-cyclopropylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)N3CCC[C@H]3C(=O)NC4CC4

DOS

IR

Vibrations