Geometry & MOs

Info

ID:	375933
PubChem CID:	134221929
Reduced:	NP2O23C27H55 (1)
Stoich.:	AB2C23D27E55 (1)
Weight, g/mol:	464.10901
ΔH_f, kcal/mol:	-1186.09
Dipole, Da:	10.07
IP(EA), eV:	-9.34(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[4-[(E)-3-(3-chloro-4,5-dimethylphenyl)-4,4,4-trifluorobut-1-enyl]phenyl]-3,3,3-trifluoropropanehydrazide

Drug info:

PubChemData

Smile

COC1C(C(OC1OCC(C(C(COP(=O)(O)OC2C(OC(C2OC)OCC(C(C(COP(=O)(O)OCCCCCN)O)O)O)CO)O)O)O)CO)O

DOS

IR

Vibrations