Geometry & MOs

Info

ID:	271264
PubChem CID:	103651937
Reduced:	NSO2C12H19 (1)
Stoich.:	ABC2D12E19 (1)
Weight, g/mol:	252.111007
ΔH_f, kcal/mol:	-86.05
Dipole, Da:	2.97
IP(EA), eV:	-8.8(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-2-methyl-N-[(3-nitrophenyl)methyl]propanamide

Drug info:

PubChemData

Smile

CC(CC1=CSC=C1)NC(=O)C(C)(C)OC

DOS

IR

Vibrations