Geometry & MOs

Info

ID:	193414
PubChem CID:	78391578
Reduced:	O3N4C30H36 (1)
Stoich.:	A3B4C30D36 (1)
Weight, g/mol:	329.99537
ΔH_f, kcal/mol:	-31.82
Dipole, Da:	16.03
IP(EA), eV:	-7.93(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(3-nitrosobut-2-en-2-ylamino)-3-sulfanylpropanoate;technetium

Drug info:

PubChemData

Smile

CC(=C1C=CC=CC1=O)NCCN(CCNC(=C2C=CC=CC2=O)C)CCNC(=C3C=CC=CC3=O)C

DOS

IR

Vibrations