Geometry & MOs

Info

ID:	75016
PubChem CID:	48422862
Reduced:	N2O3C16H22 (1)
Stoich.:	A2B3C16D22 (1)
Weight, g/mol:	306.157957
ΔH_f, kcal/mol:	-92.94
Dipole, Da:	2.32
IP(EA), eV:	-9.46(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-methyl-N-[1-(3-nitrophenyl)ethyl]propanamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(=O)NNC(=O)C(C)OCC2CC2)C

DOS

IR

Vibrations