Geometry & MOs

Info

ID:	195820
PubChem CID:	78735334
Reduced:	N3O5C22H29 (1)
Stoich.:	A3B5C22D29 (1)
Weight, g/mol:	356.162374
ΔH_f, kcal/mol:	-190.73
Dipole, Da:	4.14
IP(EA), eV:	-9.74(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,5-dimethylphenyl)methyl 3-(3,4,5-trimethoxyphenyl)prop-2-enoate

Drug info:

PubChemData

Smile

CC(C)CCC1(C(=O)N(C(=O)N1)CC(=O)OC(C2=CC=CC=C2)C(=O)NC3CC3)C

DOS

IR

Vibrations