Geometry & MOs

Info

ID:	74830
PubChem CID:	48422555
Reduced:	BrNO3C16H22 (1)
Stoich.:	ABC3D16E22 (1)
Weight, g/mol:	343.159515
ΔH_f, kcal/mol:	-93.66
Dipole, Da:	5.35
IP(EA), eV:	-8.95(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-N-methylpropanamide

Drug info:

PubChemData

Smile

CC(C(=O)N(C)CC1=C(C=CC(=C1)Br)OC)OCC2CC2

DOS

IR

Vibrations