Geometry & MOs

Info

ID:	54417
PubChem CID:	17154638
Reduced:	N3O4C22H25 (1)
Stoich.:	A3B4C22D25 (1)
Weight, g/mol:	300.111007
ΔH_f, kcal/mol:	-139.72
Dipole, Da:	6.63
IP(EA), eV:	-9.11(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-nitro-N-(3-propan-2-yloxyphenyl)benzamide

Drug info:

PubChemData

Smile

C1CC(OC1)CNC(=O)C2=CC=CC=C2NC(=O)CCNC(=O)C3=CC=CC=C3

DOS

IR

Vibrations