Geometry & MOs

Info

ID:	449200
PubChem CID:	135296771
Reduced:	NO3C14H15 (2)
Stoich.:	AB3C14D15 (2)
Weight, g/mol:	271.00195
ΔH_f, kcal/mol:	-172.35
Dipole, Da:	13.13
IP(EA), eV:	-9.04(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromopropyl N-[1-(difluoromethyl)cyclopropyl]carbamate

Drug info:

PubChemData

Smile

CC1(CC[C@H]2N1N3C=C(C(=O)C=C3C4=CC(=C(C=C24)OCCCOC5=CC=CC=C5)OC)C(=O)O)C

DOS

IR

Vibrations