Geometry & MOs

Info

ID:	76244
PubChem CID:	48424658
Reduced:	N3O4C19H27 (1)
Stoich.:	A3B4C19D27 (1)
Weight, g/mol:	320.173607
ΔH_f, kcal/mol:	-126.23
Dipole, Da:	1.58
IP(EA), eV:	-8.7(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[(4-nitrophenyl)methyl]-N-propan-2-ylpropanamide

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCN(CC1)C2=NC=CC(=C2)C(=O)OC)OCC3CC3

DOS

IR

Vibrations