Geometry & MOs

Info

ID:	203270
PubChem CID:	79805474
Reduced:	O2N3C15H21 (1)
Stoich.:	A2B3C15D21 (1)
Weight, g/mol:	290.087827
ΔH_f, kcal/mol:	-59.07
Dipole, Da:	8.16
IP(EA), eV:	-8.72(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[(2-amino-3,3,3-trifluoro-2-methylpropanoyl)amino]benzoate

Drug info:

PubChemData

Smile

CCC(C)(C(=O)NC1=CC(=CC=C1)OCCCC#N)N

DOS

IR

Vibrations