Geometry & MOs

Info

ID:	75930
PubChem CID:	48424177
Reduced:	N3O4C21H23 (1)
Stoich.:	A3B4C21D23 (1)
Weight, g/mol:	302.163043
ΔH_f, kcal/mol:	-112.49
Dipole, Da:	4.39
IP(EA), eV:	-9.04(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(3-cyanopropoxy)phenyl]-2-(cyclopropylmethoxy)propanamide

Drug info:

PubChemData

Smile

COC(=O)NC(CC1=CC=CC=C1)C(=O)NC2=CC(=CC=C2)OCCCC#N

DOS

IR

Vibrations