Geometry & MOs

Info

ID:	75850
PubChem CID:	48424067
Reduced:	NF3O5C18H22 (1)
Stoich.:	AB3C5D18E22 (1)
Weight, g/mol:	323.173273
ΔH_f, kcal/mol:	-352.46
Dipole, Da:	6.58
IP(EA), eV:	-9.62(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC(CC(=O)OC)C1=CC=C(C=C1)OC(F)(F)F)OCC2CC2

DOS

IR

Vibrations