Geometry & MOs

Info

ID:	265869
PubChem CID:	103555929
Reduced:	BrNO4C15H16 (1)
Stoich.:	ABC4D15E16 (1)
Weight, g/mol:	261.136493
ΔH_f, kcal/mol:	-127.55
Dipole, Da:	2.68
IP(EA), eV:	-9.34(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[2-(1-methoxycyclobutyl)acetyl]phenyl]-N-methylformamide

Drug info:

PubChemData

Smile

COC1(CCC1)CC(=O)C2=CC3=C(C=C2Br)NC(=O)CO3

DOS

IR

Vibrations