Geometry & MOs

Info

ID:	299044
PubChem CID:	117669940
Reduced:	O2N4C19H24 (1)
Stoich.:	A2B4C19D24 (1)
Weight, g/mol:	352.178693
ΔH_f, kcal/mol:	-70.62
Dipole, Da:	2.64
IP(EA), eV:	-8.47(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-methoxy-2-(3-methylbut-2-enyl)-5-[(E)-2-phenylethenyl]phenyl] N-aminocarbamate

Drug info:

PubChemData

Smile

CNC(=O)C1=CN=C2C(=C1NC3[C@@H]4CC5CC3CC(C4)(C5)O)C=CN2

DOS

IR

Vibrations