Geometry & MOs

Info

ID:	148294
PubChem CID:	53787956
Reduced:	N3F5C26H26 (1)
Stoich.:	A3B5C26D26 (1)
Weight, g/mol:	366.121572
ΔH_f, kcal/mol:	-179.66
Dipole, Da:	4.33
IP(EA), eV:	-8.91(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-5,7,16,18-tetraoxa-23-azahexacyclo[10.10.1.02,10.04,8.013,21.015,19]tricosa-2,4(8),9,13,15(19),20-hexaene-6-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCN1CCCC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C4=C(C=CC=N4)C(F)(F)F

DOS

IR

Vibrations