Geometry & MOs

Info

ID:	257335
PubChem CID:	103145349
Reduced:	NOC5H7 (3)
Stoich.:	ABC5D7 (3)
Weight, g/mol:	293.173942
ΔH_f, kcal/mol:	-59.67
Dipole, Da:	9.71
IP(EA), eV:	-9.32(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(tert-butylamino)-N-(2,5-dimethyl-4-nitrophenyl)propanamide

Drug info:

PubChemData

Smile

CC1CCNC(C1)C(=O)NC2=C(C=C(C(=C2)C)[N+](=O)[O-])C

DOS

IR

Vibrations