Geometry & MOs

Info

ID:	175538
PubChem CID:	75918724
Reduced:	N3O4C24H31 (1)
Stoich.:	A3B4C24D31 (1)
Weight, g/mol:	230.13068
ΔH_f, kcal/mol:	-149.49
Dipole, Da:	5.39
IP(EA), eV:	-9.49(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-phenylprop-2-enyl 2-methylpent-2-enoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCC1CCCN(C1)C(=O)C2=CC(=NC=C2)OCC3=CC=CC=C3

DOS

IR

Vibrations