Geometry & MOs

Info

ID:	203269
PubChem CID:	79805473
Reduced:	O2N3C15H25 (1)
Stoich.:	A2B3C15D25 (1)
Weight, g/mol:	275.163377
ΔH_f, kcal/mol:	-77.9
Dipole, Da:	2.66
IP(EA), eV:	-8.1(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-[3-(3-cyanopropoxy)phenyl]-2-methylbutanamide

Drug info:

PubChemData

Smile

CCC(C)(C(=O)NC1=CC=C(C=C1)OCCN(C)C)N

DOS

IR

Vibrations