Geometry & MOs

Info

ID:	218042
PubChem CID:	85088782
Reduced:	O2N3H25C27 (1)
Stoich.:	A2B3C25D27 (1)
Weight, g/mol:	423.207714
ΔH_f, kcal/mol:	19.88
Dipole, Da:	4.29
IP(EA), eV:	-8.49(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[2-(2,2-dimethylpropanoylamino)-3,5,6-trimethoxy-4-trimethylsilylphenyl]prop-2-enoate

Drug info:

PubChemData

Smile

C1CN(CCC1NC2=CC(=O)OC3=C2C=C(C=C3)C4=CC=NC=C4)C=CC5=CC=CC=C5

DOS

IR

Vibrations