Geometry & MOs

Info

ID:	164754
PubChem CID:	74447858
Reduced:	BrNO4H14C16 (1)
Stoich.:	ABC4D14E16 (1)
Weight, g/mol:	395.209658
ΔH_f, kcal/mol:	-96.6
Dipole, Da:	4.14
IP(EA), eV:	-8.79(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylpropyl 2-[(4-methylbenzoyl)amino]-3-(4-propan-2-yloxyphenyl)prop-2-enoate

Drug info:

PubChemData

Smile

CCOC(=O)C(=CC1=CC=CO1)NC(=O)C2=CC=C(C=C2)Br

DOS

IR

Vibrations