Geometry & MOs

Info

ID:	193107
PubChem CID:	78345542
Reduced:	N3O5C25H25 (1)
Stoich.:	A3B5C25D25 (1)
Weight, g/mol:	322.941633
ΔH_f, kcal/mol:	-130.04
Dipole, Da:	4.21
IP(EA), eV:	-9.19(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)N2C(C3=C(C2=O)OC4CCCCC4C3=O)C5=CC=C(C=C5)OCC(=O)N

DOS

IR

Vibrations