Geometry & MOs

Info

ID:	221967
PubChem CID:	85293030
Reduced:	OSN7C21H21 (1)
Stoich.:	ABC7D21E21 (1)
Weight, g/mol:	421.9248
ΔH_f, kcal/mol:	114.79
Dipole, Da:	7.58
IP(EA), eV:	-8.43(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=NC2=CC=CC=C2C(=O)N1NCC3=NN=C(S3)N=CC4=CC=C(C=C4)N(C)C

DOS

IR

Vibrations