Geometry & MOs

Info

ID:	368803
PubChem CID:	127330188
Reduced:	O3N5C21H25 (1)
Stoich.:	A3B5C21D25 (1)
Weight, g/mol:	340.153541
ΔH_f, kcal/mol:	-64.61
Dipole, Da:	3.79
IP(EA), eV:	-8.69(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1-methylpyrazol-4-yl)-2-oxopyrrolidin-3-yl]-3,4-dihydro-2H-chromene-4-carboxamide

Drug info:

PubChemData

Smile

CC1(CCCN1C(=O)C2=CC=CC=C2)C(=O)NC3CCN(C3=O)C4=CN(N=C4)C

DOS

IR

Vibrations