Geometry & MOs

Info

ID:	46420
PubChem CID:	10524349
Reduced:	N4C25H32 (1)
Stoich.:	A4B25C32 (1)
Weight, g/mol:	388.229683
ΔH_f, kcal/mol:	61.63
Dipole, Da:	2.47
IP(EA), eV:	-8.1(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NE)-N-(3-dodecyl-5-phenyl-6H-1,3,4-thiadiazin-2-ylidene)nitrous amide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)N2C(=C(C3=C2N=C(N=C3N(CCC=C)CC=C)C)C)C)C

DOS

IR

Vibrations