Geometry & MOs

Info

ID:	434358
PubChem CID:	135174775
Reduced:	N2C21H26 (1)
Stoich.:	A2B21C26 (1)
Weight, g/mol:	303.219829
ΔH_f, kcal/mol:	48.19
Dipole, Da:	0.64
IP(EA), eV:	-8.85(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-4-[3-[3-(propan-2-ylamino)cyclobutyl]oxyphenyl]butanal

Drug info:

PubChemData

Smile

C1CNCCC1CNCC2=CC=C(C=C2)/C=C/C3=CC=CC=C3

DOS

IR

Vibrations