Geometry & MOs

Info

ID:	148143
PubChem CID:	53787805
Reduced:	O2N4H20C23 (1)
Stoich.:	A2B4C20D23 (1)
Weight, g/mol:	317.162708
ΔH_f, kcal/mol:	41.75
Dipole, Da:	2.81
IP(EA), eV:	-8.75(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-methyl-1-prop-2-enoyloxy-3-(4-prop-1-en-2-ylphenyl)butan-2-yl]carbamic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(C(=N)C2=CC(=CC=C2)NC(=O)NC3=CC=CC4=C3OC=C4)N

DOS

IR

Vibrations