Geometry & MOs

Info

ID:	390818
PubChem CID:	135001114
Reduced:	PN2O3C16H25 (1)
Stoich.:	AB2C3D16E25 (1)
Weight, g/mol:	308.188863
ΔH_f, kcal/mol:	-155.62
Dipole, Da:	5.23
IP(EA), eV:	-9.16(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(3S)-3-methyl-1-phenylhex-5-en-3-yl]benzohydrazide

Drug info:

PubChemData

Smile

CN1[C@@H]2CCCC[C@H]2N(P1(=O)/C=C/[C@@H]3[C@H]4[C@@H]3C(=O)OCC4)C

DOS

IR

Vibrations