Geometry & MOs

Info

ID:	361234
PubChem CID:	127302398
Reduced:	O3N5C18H23 (1)
Stoich.:	A3B5C18D23 (1)
Weight, g/mol:	389.231456
ΔH_f, kcal/mol:	-70.97
Dipole, Da:	9.42
IP(EA), eV:	-9.19(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-1-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-3-methyl-1-oxopentan-2-yl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)CN1CCC(CC1)NC(=O)C2=NN(C3=CC=CC=C3C2=O)C

DOS

IR

Vibrations